In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
December 2nd, 2008 | 27 | Yes |
Popular Name: 4-[[5-(4-bromophenyl)-4-(4-ethoxyphenyl)-1,2,4-triazol-3-yl]sulfanyl]butanenitrile 4-[[5-(4-bromophenyl)-4-(4-ethox…
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 4.74 | 13.56 | -12.81 | 0 | 5 | 0 | 64 | 443.37 | 8 | ↓ |